6-azanyl-2-(butanoylamino)hexanoic acid; 1H-pyridine-2-thione

Systemtic Name: 6-azanyl-2-(butanoylamino)hexanoic acid; 1H-pyridine-2-thione Openeye Name: 6-amino-2-(butanoylamino)hexanoic acid; 1H-pyridine-2-thione CAS Name: 6-amino-2-(1-oxobutylamino)hexanoic acid; 1H-pyridine-2-thione IUPAC Name: 6-amino-2-(butanoylamino)hexanoic acid; 1H-pyridine-2-thione Traditional Name: 6-amino-2-butyramido-hexanoic acid; 1H-pyridine-2-thione Formula: C15H25N3O3S MolecularWeight: 327.4423

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC(CCCCN)C(=O)O.C1=CC(=S)NC=C1

Isomeric SMILES

CCCC(=O)NC(CCCCN)C(=O)O.C1=CC(=S)NC=C1

InChI

InChI=1S/C10H20N2O3.C5H5NS/c1-2-5-9(13)12-8(10(14)15)6-3-4-7-11;7-5-3-1-2-4-6-5/h8H,2-7,11H2,1H3,(H,12,13)(H,14,15);1-4H,(H,6,7)